1-(21Z,24Z,27Z,30Z,33Z-hexatriacontapentaenoyl)-2-(12Z,15Z,18Z,21Z,24Z,27Z-triacontahexaenoyl)-sn-glycero-3-phospho-N-(9Z,12Z,15Z-octadecatrienoyl)-ethanolamine

Properties Image MNX_ID MNXM939230 reference slm:000631615 formula C89H147NO9P global charge -1 mol weight 1406.127 InChIKey JGLUNXXZUWIUOJ-OOALETMSSA-M InChI InChI=1S/C89H148NO9P/c1-4-7-10-13-16-19-22-25-28-30-32-34-36-38-40-41-42-43-44-45-47-48-50-52-54-56-59-62-65-68-71-74-77-80-88(92)96-84-86(85-98-100(94,95)97-83-82-90-87(91)79-76-73-70-67-64-61-58-27-24-21-18-15-12-9-6-3)99-89(93)81-78-75-72-69-66-63-60-57-55-53-51-49-46-39-37-35-33-31-29-26-23-20-17-14-11-8-5-2/h7-12,16-21,25-29,32-35,38-40,46,51,53,58,86H,4-6,13-15,22-24,30-31,36-37,41-45,47-50,52,54-57,59-85H2,1-3H3,(H,90,91)(H,94,95)/p-1/b10-7-,11-8-,12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,34-32-,35-33-,40-38-,46-39-,53-51-,58-27-/t86-/m1/s1 SMILES CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)COP(=O)([O-])OCCNC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC MNX internals InChI (mnx) InChI=1/C89H148NO9P/c1-4-7-10-13-16-19-22-25-28-30-32-34-36-38-40-41-42-43-44-45-47-48-50-52-54-56-59-62-65-68-71-74-77-80-88(92)96-84-86(85-98-100(94,95)97-83-82-90-87(91)79-76-73-70-67-64-61-58-27-24-21-18-15-12-9-6-3)99-89(93)81-78-75-72-69-66-63-60-57-55-53-51-49-46-39-37-35-33-31-29-26-23-20-17-14-11-8-5-2/h7-12,16-21,25-29,32-35,38-40,46,51,53,58,86H,4-6,13-15,22-24,30-31,36-37,41-45,47-50,52,54-57,59-85H2,1-3H3,(H,90,91)(H,94,95)/b10-7-,11-8-,12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,34-32-,35-33-,40-38-,46-39-,53-51-,58-27-/t86-/m1/s1 SMILES (mnx) [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:30]/[CH:32]=[CH:34]\[CH2:36]/[CH:38]=[CH:40]\[CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:47][CH2:48][CH2:50][CH2:52][CH2:54][CH2:56][CH2:59][CH2:62][CH2:65][CH2:68][CH2:71][CH2:74][CH2:77][CH2:80][C:88](=[O:92])[O:96][CH2:84][C@H:86]([CH2:85][O:98][P:100]([OH:94])(=[O:95])[O:97][CH2:83][CH2:82][N:90]=[C:87]([CH2:79][CH2:76][CH2:73][CH2:70][CH2:67][CH2:64][CH2:61]/[CH:58]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15]/[CH:12]=[CH:9]\[CH2:6][CH3:3])[OH:91])[O:99][C:89]([CH2:81][CH2:78][CH2:75][CH2:72][CH2:69][CH2:66][CH2:63][CH2:60][CH2:57][CH2:55]/[CH:53]=[CH:51]\[CH2:49]/[CH:46]=[CH:39]\[CH2:37]/[CH:35]=[CH:33]\[CH2:31]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:93]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0